4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one

C11H11FN2O — CID 105458494

IUPAC4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one
SMILESCCc1[nH]c(=O)[nH]c1-c1ccccc1F
InChIInChI=1S/C11H11FN2O/c1-2-9-10(14-11(15)13-9)7-5-3-4-6-8(7)12/h3-6H,2H2,1H3,(H2,13,14,15)
InChIKeyILKHMIHSPPYQSL-UHFFFAOYSA-N
MW206.22 g/mol
LogP2.07
Rot. Bonds2

About 4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one

4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one (PubChem CID 105458494) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is 4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one
PubChem CID105458494
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one
SMILESCCc1[nH]c(=O)[nH]c1-c1ccccc1F
InChIInChI=1S/C11H11FN2O/c1-2-9-10(14-11(15)13-9)7-5-3-4-6-8(7)12/h3-6H,2H2,1H3,(H2,13,14,15)
InChIKeyILKHMIHSPPYQSL-UHFFFAOYSA-N
XLogP2.07
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one (CID 105458494) is 4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one is CCc1[nH]c(=O)[nH]c1-c1ccccc1F.
What is the InChIKey of 4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one?
The InChIKey is ILKHMIHSPPYQSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-2-9-10(14-11(15)13-9)7-5-3-4-6-8(7)12/h3-6H,2H2,1H3,(H2,13,14,15).
What are the key properties of 4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one?
4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one has a molecular weight of 206.22 g/mol, XLogP of 2.07, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 105458494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).